N-[(3S,7S,8aS)-2-acetyl-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]-3-fluorobenzamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-2-acetyl-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]-3-fluorobenzamide
N-[(3S,7S,8aS)-2-acetyl-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]-3-fluorobenzamide
Compound characteristics
| Compound ID: | S974-2953 |
| Compound Name: | N-[(3S,7S,8aS)-2-acetyl-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]-3-fluorobenzamide |
| Molecular Weight: | 333.36 |
| Molecular Formula: | C17 H20 F N3 O3 |
| Smiles: | CC(N1C[C@@H]2C[C@@H](CN2C([C@@H]1C)=O)NC(c1cccc(c1)F)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4469 |
| logD: | 0.4469 |
| logSw: | -1.8604 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.325 |
| InChI Key: | GBBYELXRUVHGKD-WKPIXPDZSA-N |